2,5-dimethyl-N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]benzenesulfonamide

Systemtic Name: 2,5-dimethyl-N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]benzenesulfonamide Openeye Name: 2,5-dimethyl-N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]benzenesulfonamide CAS Name: 2,5-dimethyl-N-[(2R)-3-methyl-2-(4-morpholin-4-iumyl)butyl]benzenesulfonamide IUPAC Name: 2,5-dimethyl-N-[(2R)-3-methyl-2-morpholin-4-ium-4-ylbutyl]benzenesulfonamide Traditional Name: 2,5-dimethyl-N-[(2R)-3-methyl-2-morpholin-4-ium-4-yl-butyl]benzenesulfonamide Formula: C17H29N2O3S+ MolecularWeight: 341.48876

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC1=CC(=C(C=C1)C)S(=O)(=O)NCC(C(C)C)[NH+]2CCOCC2

Isomeric SMILES

CC1=CC(=C(C=C1)C)S(=O)(=O)NC[C@@H](C(C)C)[NH+]2CCOCC2

InChI

InChI=1S/C17H28N2O3S/c1-13(2)16(19-7-9-22-10-8-19)12-18-23(20,21)17-11-14(3)5-6-15(17)4/h5-6,11,13,16,18H,7-10,12H2,1-4H3/p+1/t16-/m0/s1